CID 20014

O-cresol, alpha,alpha'-(hexamethylenedinitrilo)di-

Structural Information

Molecular Formula
C20H24N2O2
SMILES
C1=CC=C(C(=C1)CN=CCCCCC=NCC2=CC=CC=C2O)O
InChI
InChI=1S/C20H24N2O2/c23-19-11-5-3-9-17(19)15-21-13-7-1-2-8-14-22-16-18-10-4-6-12-20(18)24/h3-6,9-14,23-24H,1-2,7-8,15-16H2
InChIKey
CRGRLOKWPRTHCA-UHFFFAOYSA-N
Compound name
2-[[6-[(2-hydroxyphenyl)methylimino]hexylideneamino]methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.18378 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.19106 178.8
[M+Na]+ 347.17300 183.5
[M-H]- 323.17650 184.6
[M+NH4]+ 342.21760 192.2
[M+K]+ 363.14694 178.0
[M+H-H2O]+ 307.18104 169.6
[M+HCOO]- 369.18198 204.0
[M+CH3COO]- 383.19763 213.4
[M+Na-2H]- 345.15845 183.0
[M]+ 324.18323 180.6
[M]- 324.18433 180.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.